methyl (3S)-4-oxidanylidene-3-(phenylmethoxymethoxy)butanoate

Systemtic Name: methyl (3S)-4-oxidanylidene-3-(phenylmethoxymethoxy)butanoate Openeye Name: methyl (3S)-3-(benzyloxymethoxy)-4-oxo-butanoate CAS Name: (3S)-4-oxo-3-(phenylmethoxymethoxy)butanoic acid methyl ester IUPAC Name: methyl (3S)-4-oxo-3-(phenylmethoxymethoxy)butanoate Traditional Name: (3S)-3-(benzoxymethoxy)-4-keto-butyric acid methyl ester Formula: C13H16O5 MolecularWeight: 252.26314

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C=O)OCOCC1=CC=CC=C1

Isomeric SMILES

COC(=O)C[C@@H](C=O)OCOCC1=CC=CC=C1

InChI

InChI=1S/C13H16O5/c1-16-13(15)7-12(8-14)18-10-17-9-11-5-3-2-4-6-11/h2-6,8,12H,7,9-10H2,1H3/t12-/m0/s1